4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide

C20H26N4O2 — CID 122572179

IUPAC4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
SMILESCC(C)(CNC(=O)c1ccc(-c2ccncc2N)cc1)N1CCOCC1
InChIInChI=1S/C20H26N4O2/c1-20(2,24-9-11-26-12-10-24)14-23-19(25)16-5-3-15(4-6-16)17-7-8-22-13-18(17)21/h3-8,13H,9-12,14,21H2,1-2H3,(H,23,25)
InChIKeyYYUYTJCUCMSKJM-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.17
Rot. Bonds5

About 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide

4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide (PubChem CID 122572179) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide.

Molecular Properties

Compound Name4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
PubChem CID122572179
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC Name4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
SMILESCC(C)(CNC(=O)c1ccc(-c2ccncc2N)cc1)N1CCOCC1
InChIInChI=1S/C20H26N4O2/c1-20(2,24-9-11-26-12-10-24)14-23-19(25)16-5-3-15(4-6-16)17-7-8-22-13-18(17)21/h3-8,13H,9-12,14,21H2,1-2H3,(H,23,25)
InChIKeyYYUYTJCUCMSKJM-UHFFFAOYSA-N
XLogP2.17
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide?
The IUPAC name of 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide (CID 122572179) is 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide.
What is the SMILES notation for 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide?
The canonical SMILES for 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide is CC(C)(CNC(=O)c1ccc(-c2ccncc2N)cc1)N1CCOCC1.
What is the InChIKey of 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide?
The InChIKey is YYUYTJCUCMSKJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-20(2,24-9-11-26-12-10-24)14-23-19(25)16-5-3-15(4-6-16)17-7-8-22-13-18(17)21/h3-8,13H,9-12,14,21H2,1-2H3,(H,23,25).
What are the key properties of 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide?
4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide has a molecular weight of 354.45 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide is sourced from PubChem (CID 122572179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).